Anhydrovinblastine

CAS Registry Number®

38390-45-3
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CAS Name

Anhydrovinblastine

Molecular Formula

C46H56N4O8

Molecular Mass

792.96

Cite this Page

Anhydrovinblastine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=38390-45-3 (retrieved 2024-05-03) (CAS RN: 38390-45-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C46H56N4O8/c1-8-28-21-29-24-45(41(52)56-6,37-31(15-19-49(25-28)26-29)30-13-10-11-14-34(30)47-37)33-22-32-35(23-36(33)55-5)48(4)39-44(32)17-20-50-18-12-16-43(9-2,38(44)50)40(58-27(3)51)46(39,54)42(53)57-7/h10-14,16,21-23,29,38-40,47,54H,8-9,15,17-20,24-26H2,1-7H3/t29-,38-,39+,40+,43+,44+,45-,46-/m0/s1

InChIKey

InChIKey=FFRFGVHNKJYNOV-ZCIMLLHDSA-N

SMILES

C(C)[C@@]12[C@]3([C@@]4([C@]([C@](C(OC)=O)(O)[C@@H]1OC(C)=O)(N(C)C=5C4=CC(=C(OC)C5)[C@]6(C(OC)=O)C7=C(C=8C(N7)=CC=CC8)CC[N@@]9C[C@](C6)(C=C(CC)C9)[H])[H])CCN3CC=C2)[H]

Canonical SMILES

O=C(OC1C(O)(C(=O)OC)C2N(C3=CC(OC)=C(C=C3C42CCN5CC=CC1(CC)C54)C6(C(=O)OC)C=7NC=8C=CC=CC8C7CCN9CC(=CC(C9)C6)CC)C)C

Other Names for this Substance

  • Vincaleukoblastine, 3′,4′-didehydro-4′-deoxy-
  • 1H-Indolizino[8,1-cd]carbazole, vincaleukoblastine deriv.
  • 2H-3,7-Methanoazacycloundecino[5,4-b]indole, vincaleukoblastine deriv.
  • 3′,4′-Didehydro-4′-deoxyvincaleukoblastine
  • 3′,4′-Didehydroisoleurosine

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Deleted or Replaced CAS Registry Numbers

57694-66-3, 119264-84-5, 120478-94-6, 1076210-07-5, 1263285-71-7, 1620695-06-8, 2475028-78-3

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